N-butan-2-yl-2-(chloromethyl)-N-methyl-4-nitro-aniline

Systemtic Name: N-butan-2-yl-2-(chloromethyl)-N-methyl-4-nitro-aniline Openeye Name: 2-(chloromethyl)-N-methyl-4-nitro-N-sec-butyl-aniline CAS Name: N-butan-2-yl-2-(chloromethyl)-N-methyl-4-nitroaniline IUPAC Name: N-butan-2-yl-2-(chloromethyl)-N-methyl-4-nitroaniline Traditional Name: [2-(chloromethyl)-4-nitro-phenyl]-methyl-sec-butyl-amine Formula: C12H17ClN2O2 MolecularWeight: 256.72858

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(C)C1=C(C=C(C=C1)[N+](=O)[O-])CCl

Isomeric SMILES

CCC(C)N(C)C1=C(C=C(C=C1)[N+](=O)[O-])CCl

InChI

InChI=1S/C12H17ClN2O2/c1-4-9(2)14(3)12-6-5-11(15(16)17)7-10(12)8-13/h5-7,9H,4,8H2,1-3H3